2-butyl-4,5-diphenyl-1H-imidazole

C19H20N2 — CID 14710025

IUPAC2-butyl-4,5-diphenyl-1H-imidazole
SMILESCCCCc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1
InChIInChI=1S/C19H20N2/c1-2-3-14-17-20-18(15-10-6-4-7-11-15)19(21-17)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3,(H,20,21)
InChIKeyAVTLTWGTYRLMEQ-UHFFFAOYSA-N
MW276.38 g/mol
LogP5.09
Rot. Bonds5

About 2-butyl-4,5-diphenyl-1H-imidazole

2-butyl-4,5-diphenyl-1H-imidazole (PubChem CID 14710025) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-butyl-4,5-diphenyl-1H-imidazole.

Molecular Properties

Compound Name2-butyl-4,5-diphenyl-1H-imidazole
PubChem CID14710025
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name2-butyl-4,5-diphenyl-1H-imidazole
SMILESCCCCc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1
InChIInChI=1S/C19H20N2/c1-2-3-14-17-20-18(15-10-6-4-7-11-15)19(21-17)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3,(H,20,21)
InChIKeyAVTLTWGTYRLMEQ-UHFFFAOYSA-N
XLogP5.09
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.38
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-butyl-4,5-diphenyl-1H-imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-butyl-4,5-diphenyl-1H-imidazole?
The IUPAC name of 2-butyl-4,5-diphenyl-1H-imidazole (CID 14710025) is 2-butyl-4,5-diphenyl-1H-imidazole.
What is the SMILES notation for 2-butyl-4,5-diphenyl-1H-imidazole?
The canonical SMILES for 2-butyl-4,5-diphenyl-1H-imidazole is CCCCc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1.
What is the InChIKey of 2-butyl-4,5-diphenyl-1H-imidazole?
The InChIKey is AVTLTWGTYRLMEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-2-3-14-17-20-18(15-10-6-4-7-11-15)19(21-17)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3,(H,20,21).
What are the key properties of 2-butyl-4,5-diphenyl-1H-imidazole?
2-butyl-4,5-diphenyl-1H-imidazole has a molecular weight of 276.38 g/mol, XLogP of 5.09, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-4,5-diphenyl-1H-imidazole is sourced from PubChem (CID 14710025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).